1-[5-isocyano-2-(4-methylsulfanylphenoxy)phenyl]-N-methyl-methanamine

Systemtic Name: 1-[5-isocyano-2-(4-methylsulfanylphenoxy)phenyl]-N-methyl-methanamine Openeye Name: 1-[5-isocyano-2-(4-methylsulfanylphenoxy)phenyl]-N-methyl-methanamine CAS Name: 1-[5-isocyano-2-[4-(methylthio)phenoxy]phenyl]-N-methylmethanamine IUPAC Name: 1-[5-isocyano-2-(4-methylsulfanylphenoxy)phenyl]-N-methylmethanamine Traditional Name: [5-isocyano-2-[4-(methylthio)phenoxy]benzyl]-methyl-amine Formula: C16H16N2OS MolecularWeight: 284.37604

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=C(C=CC(=C1)[N+]#[C-])OC2=CC=C(C=C2)SC

Isomeric SMILES

CNCC1=C(C=CC(=C1)[N+]#[C-])OC2=CC=C(C=C2)SC

InChI

InChI=1S/C16H16N2OS/c1-17-11-12-10-13(18-2)4-9-16(12)19-14-5-7-15(20-3)8-6-14/h4-10,17H,11H2,1,3H3